科华智慧（深圳）创新药物研发有限公司-天然产物化合物库-创新药物研发-波谱智能解析-化合物冷冻电镜结构解析

天然产物数据库

您可快速检索70万⁺天然产物信息

检索最多: 白僵菌素大品种冬虫夏草人参三七党参大戟决明半夏丁香

CAS No.	英文名/中文名/SMILES	分子式	分子量
130676-64-1	(S)-3-Hexyl-5,6-dihydro-6-undecyl-2H-pyran-2-one Orlistat Impurity CCCCCCCCCCCC1CC=C(C(=O)O1)CCCCCC	C₂₂H₄₀O₂	336.6
106401-68-7	Daunorubicin bromoketal 阿霉素杂质B CC1C(C(CC(O1)OC2CC(CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)(C(CBr)(OC)OC)O)N)O	C₂₉H₃₄BRNO₁₁	652.5
26159-35-3	Naproxen Methyl Ester (S)-Naproxen Methyl Ester CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)OC	C₁₅H₁₆O₃	244.28
2959-04-8	1-(4,6-Diamino-1,3,5-triazin-2-yl)guanidine hydrochloride Guanylmelamine Hydrochloride C1(=NC(=NC(=N1)N=C(N)N)N)N.Cl	C₄H₉ClN₈	204.62
72578-71-3	3-(2-Chloroactyl)-2-[(2-chloroethyl)amino]tetrahydro-2H-1,3,2-oxazaphosphorine-2-oxide 3-(2-氯乙酰基)-2-[(2-氯乙基)氨基]四氢-2H-1,3,2-磷-2-氧化物 C1CN(P(=O)(OC1)NCCCl)C(=O)CCl	C₇H₁₃Cl₂N₂O₃P	275.07
1346598-28-4	Unii-MJ2A99A26H 兰索拉唑杂质H CC1=C(C=CN2C1=C(N3C2=NC4=CC=CC=C43)SC5=NC6=CC=CC=C6N5)OCC(F)(F)F	C₂₃H₁₆F₃N₅OS	467.5
1625-11-2	21-Acetoxy-11beta,17-dihydroxy-6alpha-methylpregn-4-ene-3,20-dione 6α-Methyl Hydrocortisone 21-Acetate CC1CC2C3CCC(C3(CC(C2C4(C1=CC(=O)CC4)C)O)C)(C(=O)COC(=O)C)O	C₂₄H₃₄O₆	418.5
17812-46-3	Ipratropium Bromide impurity F 异丙托溴铵杂质F CC(C)[N+]1(C2CCC23C1CC(C3)OC(=O)C(=C)C4=CC=CC=C4)C.[Br-]	C₂₁H₂₈BRNO₂	406.4
150322-38-6	5-(2-Cyclopropyl-1-(2-fluorophenyl)-2-oxoethyl)-5,6,7,7a-tetrahydrothieno[3,2-c]pyridin-2(4H)-one 5-[2-环丙基-1-(2-氟苯基)-2-氧代乙基]-5,6,7,7A-四氢噻吩并[3,2-C]吡啶-2(4H)-酮 C1CC1C(=O)C(C2=CC=CC=C2F)N3CCC4C(=CC(=O)S4)C3	C₁₈H₁₈FNO₂S	331.4
117-38-4	Sulfamidopyrine [(2,3-Dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino]methanesulfonic acid CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NCS(=O)(=O)O	C₁₂H₁₅N₃O₄S	297.33